3-methyl-N-[1-oxidanylidene-1-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]propan-2-yl]benzamide

Systemtic Name: 3-methyl-N-[1-oxidanylidene-1-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]propan-2-yl]benzamide Openeye Name: 3-methyl-N-[1-methyl-2-oxo-2-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]ethyl]benzamide CAS Name: 3-methyl-N-[1-oxo-1-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]propan-2-yl]benzamide IUPAC Name: 3-methyl-N-[1-oxo-1-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]propan-2-yl]benzamide Traditional Name: N-[2-keto-1-methyl-2-[[4-(1,2,4-triazol-1-ylmethyl)benzyl]amino]ethyl]-3-methyl-benzamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C)C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(C)C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C21H23N5O2/c1-15-4-3-5-19(10-15)21(28)25-16(2)20(27)23-11-17-6-8-18(9-7-17)12-26-14-22-13-24-26/h3-10,13-14,16H,11-12H2,1-2H3,(H,23,27)(H,25,28)